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305381-67-3,MFCD03086163
Catalog No.:AA0030EN

305381-67-3 | 1-Methylbenzotriazole-5-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$21.00   $15.00
- +
500mg
95%
in stock  
$76.00   $53.00
- +
1g
97%
in stock  
$95.00   $67.00
- +
5g
97%
in stock  
$261.00   $183.00
- +
10g
97%
in stock  
$427.00   $299.00
- +
25g
97%
in stock  
$760.00   $532.00
- +
100g
97%
in stock  
$1,640.00   $1,148.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0030EN
Chemical Name:
1-Methylbenzotriazole-5-carboxylic acid
CAS Number:
305381-67-3
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
MDL Number:
MFCD03086163
SMILES:
OC(=O)c1ccc2c(c1)nnn2C
Properties
Computed Properties
 
Complexity:
221  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
0.7  

Downstream Synthesis Route
1.3-dimethyl-5-carboxy-benztriazoliumchloride 
  305381-67-3 

[1]JustusLiebigsAnnalenderChemie,1896,vol.291,p.336

[1]Patent:US2012/277224,2012,A1.Locationinpatent:Page/Pagecolumn41

[2]Patent:WO2005/30704,2005,A1.Locationinpatent:Page/Pagecolumn246

[1]Patent:US6589915,2003,B1

[1]Patent:US6541423,2003,B1

[1]Patent:US2012/277224,2012,A1

Literature

Title: 1-Alkyl-benzotriazole-5-carboxylic acids are highly selective agonists of the human orphan G-protein-coupled receptor GPR109b.

Journal: Journal of medicinal chemistry 20060223

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SDS
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